N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine

C15H26N4 — CID 62592540

IUPACN-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine
SMILESCCNCC1CCCN(c2cc(C(C)C)ncn2)C1
InChIInChI=1S/C15H26N4/c1-4-16-9-13-6-5-7-19(10-13)15-8-14(12(2)3)17-11-18-15/h8,11-13,16H,4-7,9-10H2,1-3H3
InChIKeyIVHRJVFBCFSKRE-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.43
Rot. Bonds5

About N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine

N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine (PubChem CID 62592540) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine
PubChem CID62592540
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC NameN-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine
SMILESCCNCC1CCCN(c2cc(C(C)C)ncn2)C1
InChIInChI=1S/C15H26N4/c1-4-16-9-13-6-5-7-19(10-13)15-8-14(12(2)3)17-11-18-15/h8,11-13,16H,4-7,9-10H2,1-3H3
InChIKeyIVHRJVFBCFSKRE-UHFFFAOYSA-N
XLogP2.43
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(6-propoxypyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine
CID 66331580
N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine
CID 62592708
2-methyl-N-[[1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-yl]methyl]propan-1-amine
CID 106973651
4-[3-(ethylaminomethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 136989738
N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]ethanamine
CID 106550545
2-methoxy-N-[[1-(6-methoxypyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine
CID 66320112
N-[[1-(6-propylpyrimidin-4-yl)piperidin-3-yl]methyl]cyclopropanamine
CID 62586350
N-[(1-quinazolin-4-ylpiperidin-3-yl)methyl]ethanamine
CID 62593559
2-[[1-(6-methoxypyrimidin-4-yl)piperidin-3-yl]methylamino]acetic acid
CID 106814254
4-propan-2-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyrimidine
CID 72871048
N-[[1-(6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]methyl]ethanamine
CID 66333648
4-(3-chloro-4-methylpiperidin-1-yl)-6-propan-2-ylpyrimidine
CID 102960858

Frequently Asked Questions

What is the IUPAC name of N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine?
The IUPAC name of N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine (CID 62592540) is N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine is CCNCC1CCCN(c2cc(C(C)C)ncn2)C1.
What is the InChIKey of N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine?
The InChIKey is IVHRJVFBCFSKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-16-9-13-6-5-7-19(10-13)15-8-14(12(2)3)17-11-18-15/h8,11-13,16H,4-7,9-10H2,1-3H3.
What are the key properties of N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine?
N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine has a molecular weight of 262.40 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine is sourced from PubChem (CID 62592540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).